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Bioconcentration Factor of Polychlorinated Biphenyls and Its Correlation with UV- and IR-Spectroscopic data: A DFT based Study

Online Journal of Chemistry | Vol 1, Issue 1

Table 1. Biphenyl and PCB congeners withtheir experimental logarithmic BCF [30]

S.N.Chemical NameLogBCFS.N.Chemical NameLogBCF
1Biphenyl2.64302,3,3",4,4"-pentachloro-5.00
24-chloro-2.77312,3,3",4,6-pentachloro-5.00
32,2"-dichloro-3.38322,3",4,4",5-pentachloro-5.00
42,3-dichloro-4.11333,3",4,4",5-pentachloro-5.81
52,3"-dichloro-3.80342,2",3,3",4,4"-hexachloro-5.77
62,4-dichloro-3.55352,2"3,3",6,6"-hexachloro-5.43
72,4"-dichloro-3.57362,2",3,4,4",5-hexachloro-5.88
82,5-dichloro-3.89372,2"3,4,4",5"-hexachloro-5.39
93,5-dichloro-3.78382,2",3,4,5,5"-hexachloro-5.81
104,4"-dichloro-3.28392,2",3,4",5,6"-hexachloro-5.39
112,2",5-trichloro-4.11402,2",3,5,5",6-hexachloro-5.54
122,4,4"-trichloro-4.20412,2",4,4",5,5"-hexachloro-5.65
132,4,5-trichloro-4.26422,2",4,4",6,6"-hexachloro-4.93
142,4",5-trichloro-4.23432,3,3",4,4",5-hexachloro-5.39
152,2",3,3"-tetrachloro-4.23442,3,3",4,4",5"-hexachloro-5.39
162,2",3,5"-tetrachloro-4.84453,3",4,4",5,5"-hexachloro-5.97
172,2",4,4"-tetrachloro-4.85462,2",3,3",4,5,6"-heptachloro-5.80
182,2",4,5-tetrachloro-5.00472,2",3,4,4",5,5"-heptachloro-5.80
192,2",4,5"-tetrachloro-4.84482,2",3,4,4",5,6"-heptachloro-5.80
202,2",5,5"-tetrachloro-4.63492,2",3,4,4",5",6-heptachloro-5.84
212,2",6,6"-tetrachloro-3.85502,2",3,4",5,5",6-heptachloro-5.80
222,3,4",6-tetrachloro-4.60512,3,3",4,4",5",6-heptachloro-5.84
232,3",4",5-tetrachloro-4.77522,2",3,3",4,4"5,5"-octachloro-5.81
243,3",4,4"-tetrachloro-4.59532,2",3,3",4,4"5,6-octachloro-5.92
252,2",3,4,5"-pentachloro-5.38542,2",3,3",4,4"5,6"-octachloro-5.92
262,2",3,4",5-pentachloro-5.00552,2",3,3",4, 5,5",6-octachloro-5.88
272,2",3",4,5"-pentachloro-5.43562,2",3,3",5,5",6,6"-octachloro-5.82
282,2",4,4",5-pentachloro-5.00572,2",3,3",4,5,5",6,6"-nonachloro-5.71
292,2",4,5,5"-pentachloro-5.4058Decachloro-5.44
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